1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

C107H124F6N28O7 — CID 158196481

About 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone (PubChem CID 158196481) has the molecular formula C107H124F6N28O7 and a molecular weight of 2028.35 g/mol. Its IUPAC name is 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone.

Molecular Properties

• Compound Name: 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
• PubChem CID: 158196481
• Molecular Formula: C107H124F6N28O7
• Molecular Weight: 2028.35 g/mol
• Exact Mass: 2027.01
• IUPAC Name: 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
• SMILES: CC(=O)N1CCc2c(c(N(C)c3ccc(-c4cn(C)nc4C(F)(F)F)cc3)nn2C)C1.CC(=O)N1CCc2c(c(N(C)c3ccc(-c4cn(C)nc4C(F)(F)F)cc3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(N(C)c3ccc(-c4cnn(C)c4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(N3CCCc4ccccc43)nn2C)C1.CC(=O)N1CCc2c(c(N3CCc4cc(-c5cnn(C)c5)ccc43)nn2C2CCOC2)C1
• InChI: InChI=1S/C24H27F3N6O2.C24H28N6O2.C21H23F3N6O.C20H24N6O.C18H22N4O/c1-15(34)32-10-8-21-20(13-32)23(29-33(21)18-9-11-35-14-18)31(3)17-6-4-16(5-7-17)19-12-30(2)28-22(19)24(25,26)27;1-16(31)28-8-6-23-21(14-28)24(26-30(23)20-7-10-32-15-20)29-9-5-18-11-17(3-4-22(18)29)19-12-25-27(2)13-19;1-13(31)30-10-9-18-17(12-30)20(26-29(18)4)28(3)15-7-5-14(6-8-15)16-11-27(2)25-19(16)21(22,23)24;1-14(27)26-10-9-19-18(13-26)20(22-25(19)4)24(3)17-7-5-15(6-8-17)16-11-21-23(2)12-16;1-13(23)21-11-9-17-15(12-21)18(19-20(17)2)22-10-5-7-14-6-3-4-8-16(14)22/h4-7,12,18H,8-11,13-14H2,1-3H3;3-4,11-13,20H,5-10,14-15H2,1-2H3;5-8,11H,9-10,12H2,1-4H3;5-8,11-12H,9-10,13H2,1-4H3;3-4,6,8H,5,7,9-12H2,1-2H3
• InChIKey: GAJYJIAXQDUDIP-UHFFFAOYSA-N
• XLogP: 15.19
• TPSA: 296.59 Ų
• H-Bond Acceptors: 30
• Rotatable Bonds: 14
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2028.35
LogP ≤ 5	15.19
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

The IUPAC name of 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone (CID 158196481) is 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone.

What is the SMILES notation for 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

The canonical SMILES for 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone is CC(=O)N1CCc2c(c(N(C)c3ccc(-c4cn(C)nc4C(F)(F)F)cc3)nn2C)C1.CC(=O)N1CCc2c(c(N(C)c3ccc(-c4cn(C)nc4C(F)(F)F)cc3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(N(C)c3ccc(-c4cnn(C)c4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(N3CCCc4ccccc43)nn2C)C1.CC(=O)N1CCc2c(c(N3CCc4cc(-c5cnn(C)c5)ccc43)nn2C2CCOC2)C1.

What is the InChIKey of 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

The InChIKey is GAJYJIAXQDUDIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27F3N6O2.C24H28N6O2.C21H23F3N6O.C20H24N6O.C18H22N4O/c1-15(34)32-10-8-21-20(13-32)23(29-33(21)18-9-11-35-14-18)31(3)17-6-4-16(5-7-17)19-12-30(2)28-22(19)24(25,26)27;1-16(31)28-8-6-23-21(14-28)24(26-30(23)20-7-10-32-15-20)29-9-5-18-11-17(3-4-22(18)29)19-12-25-27(2)13-19;1-13(31)30-10-9-18-17(12-30)20(26-29(18)4)28(3)15-7-5-14(6-8-15)16-11-27(2)25-19(16)21(22,23)24;1-14(27)26-10-9-19-18(13-26)20(22-25(19)4)24(3)17-7-5-15(6-8-17)16-11-21-23(2)12-16;1-13(23)21-11-9-17-15(12-21)18(19-20(17)2)22-10-5-7-14-6-3-4-8-16(14)22/h4-7,12,18H,8-11,13-14H2,1-3H3;3-4,11-13,20H,5-10,14-15H2,1-2H3;5-8,11H,9-10,12H2,1-4H3;5-8,11-12H,9-10,13H2,1-4H3;3-4,6,8H,5,7,9-12H2,1-2H3.

What are the key properties of 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?

1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone has a molecular weight of 2028.35 g/mol, XLogP of 15.19, 14 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-yl]-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone is sourced from PubChem (CID 158196481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).